Skip to main content
Free research Free research Free compound review with research home and workspace preview
Quick search ChEMBL 36
Compound Detail

CHEMBL368109

Enter ChEMBL ID:
Free Research Context This compound will appear in recent viewed items on the research home for this browser.
Research home View demo workspace
O=C1NC(c2ccccc2)(c2ccccc2)C(=O)N1CC#CCN1CCCC1

Basic Information

ChEMBL ID CHEMBL368109
Phase Preclinical
Structure Type MOL
InChI Key LFYOFNAHUKMYKZ-UHFFFAOYSA-N
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names

Molecular Properties

373.5
MW (Da)
2.58
ALogP
3
HBA
1
HBD
52.6
PSA (Ų)
0.66
QED
0
Ro5 Violations
4
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C23H23N3O2
MW 373.46
Aromatic Rings 2
Heavy Atoms 28
NP-Likeness -0.87

Activity Summary

Ki 1 meas. best 6.19

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
Muscarinic acetylcholine receptor M1
CHEMBL276
Ki 6.19 6.19 640.0 1

Activity Data Samples

Top measurements by pChEMBL value

Literature References

PubMed DOI Target Context # Activities
- 10.1016/S0960-894X(97)00143-1 Muscarinic acetylcholine receptor M1 1
- 10.1016/S0960-894X(97)00143-1 Muscarinic acetylcholine receptor M2 1

Data from ChEMBL 36 via Core Engine